8018-3294 Screening compound: N-{[3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-N-[(furan-2-yl)methyl]ethane-1-sulfonamide

8018-3294 Screening compound: N-{[3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-N-[(furan-2-yl)methyl]ethane-1-sulfonamide
8018-3294 Screening compound: N-{[3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-N-[(furan-2-yl)methyl]ethane-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-3294
N-{[3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-N-[(furan-2-yl)methyl]ethane-1-sulfonamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

8018-3294

Molecular Formula

C18H21N3O5S (C18 H21 N3 O5 S)

Compound Name

N-{[3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-N-[(furan-2-yl)methyl]ethane-1-sulfonamide

IUPAC name

N-{[3-(2-ethoxyphenyl)-124-oxadiazol-5-yl]methyl}-N-[(furan-2-yl)methyl]ethane-1-sulfonamide

SMILES

CCOc(cccc1)c1-c1noc(CN(Cc2ccco2)S(CC)(=O)=O)n1

InChI

InChI=1S/C18H21N3O5S/c1-3-24-16-10-6-5-9-15(16)18-19-17(26-20-18)13-21(27(22,23)4-2)12-14-8-7-11-25-14/h5-11H,3-4,12-13H2,1-2H3

InChI Key

JLSQPHNVPGBPIK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07396545

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.45

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.086

Distribution Coefficient, logD

3.086

Water Solubility, LogSw

-3.52

Polar Surface Area

77.810

Acid Dissociation Constant (pKa)

21.51

Base Dissociation Constant (pKb)

-3.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

8018-3294 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8018-3294 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-3294?
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What is the minimum amount of 8018-3294 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-3294
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-3294
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 8018-3294 available by request